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2,3-Diamino-5-bromopyridine

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Name

2,3-Diamino-5-bromopyridine

EINECS 254-172-9
CAS No. 38875-53-5 Density 1.818 g/cm3
PSA 64.93000 LogP 2.17090
Solubility soluble in hot water Melting Point 155 °C (dec.)(lit.)
Formula C5H6BrN3 Boiling Point 320.9 °C at 760 mmHg
Molecular Weight 188.027 Flash Point 147.9 °C
Transport Information N/A Appearance light yellow to purple or light brown powder
Safety 26-36-37/39-45-36/37/39 Risk Codes 36/37/38-34
Molecular Structure Molecular Structure of 38875-53-5 (2,3-Diamino-5-bromopyridine) Hazard Symbols IrritantXi; CorrosiveC
Synonyms

Pyridine,2,3-diamino-5-bromo- (6CI,7CI);5-Bromo-2,3-diaminopyridine;5-Bromo-2,3-pyridinediamine;

Article Data 24

2,3-Diamino-5-bromopyridine Specification

The 2,3-Diamino-5-bromopyridine, with the CAS registry number 38875-53-5 and EINECS registry number 254-172-9, has the systematic name of 5-bromopyridine-2,3-diamine. It is a kind of light yellow to purple or light brown powder, and belongs to the following product categories: Halides; Pyridines; Pyridine; Bromopyridines; Halopyridines; Chiral chemicals; Heterocyclic Building Blocks; Halogenated Heterocycles; Heterocyclic Building Blocks. And the molecular formula of this chemical is C5H6BrN3.

The physical properties of 2,3-Diamino-5-bromopyridine are as followings: (1)ACD/LogP: 2.03; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2; (4)ACD/LogD (pH 7.4): 2.03; (5)ACD/BCF (pH 5.5): 19.4; (6)ACD/BCF (pH 7.4): 20.51; (7)ACD/KOC (pH 5.5): 286; (8)ACD/KOC (pH 7.4): 302.46; (9)#H bond acceptors: 3; (10)#H bond donors: 4; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 19.37 Å2; (13)Index of Refraction: 1.712; (14)Molar Refractivity: 40.5 cm3; (15)Molar Volume: 103.4 cm3; (16)Polarizability: 16.05×10-24cm3; (17)Surface Tension: 74.3 dyne/cm; (18)Density: 1.818 g/cm3; (19)Flash Point: 147.9 °C; (20)Enthalpy of Vaporization: 56.26 kJ/mol; (21)Boiling Point: 320.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000308 mmHg at 25°C.

Uses of 2,3-Diamino-5-bromopyridine: It can react with acetic acid anhydride to produce 2,3-bis-acetylamino-5-bromo-pyridine. This reaction will need solvent acetic acid and heating. And the yield is about 88%. 

2,3-Diamino-5-bromopyridine can react with acetic acid anhydride to produce 2,3-bis-acetylamino-5-bromo-pyridine

You should be cautious while dealing with this chemical. It irritates eyes, respiratory system and skin, and may cause burns as well. Therefore, you had better take the following instructions: Wear suitable protective clothing, gloves and eye/face protection, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice; In case of accident or if you feel unwell, seek medical advice immediately (show label where possible).

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cnc(N)c(N)c1
(2)InChI: InChI=1/C5H6BrN3/c6-3-1-4(7)5(8)9-2-3/h1-2H,7H2,(H2,8,9)
(3)InChIKey: YRGMYJUKFJPNPD-UHFFFAOYAR

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